1-[1,1-bis(oxidanylidene)thiolan-3-yl]-N-(4-iodanyl-2-methyl-phenyl)-6-oxidanylidene-4,5-dihydropyridazine-3-carboxamide

Systemtic Name: 1-[1,1-bis(oxidanylidene)thiolan-3-yl]-N-(4-iodanyl-2-methyl-phenyl)-6-oxidanylidene-4,5-dihydropyridazine-3-carboxamide Openeye Name: 1-(1,1-dioxothiolan-3-yl)-N-(4-iodo-2-methyl-phenyl)-6-oxo-4,5-dihydropyridazine-3-carboxamide CAS Name: 1-(1,1-dioxo-3-thiolanyl)-N-(4-iodo-2-methylphenyl)-6-oxo-4,5-dihydropyridazine-3-carboxamide IUPAC Name: 1-(1,1-dioxothiolan-3-yl)-N-(4-iodo-2-methylphenyl)-6-oxo-4,5-dihydropyridazine-3-carboxamide Traditional Name: 1-(1,1-diketothiolan-3-yl)-N-(4-iodo-2-methyl-phenyl)-6-keto-4,5-dihydropyridazine-3-carboxamide Formula: C16H18IN3O4S MolecularWeight: 475.30129

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)I)NC(=O)C2=NN(C(=O)CC2)C3CCS(=O)(=O)C3

Isomeric SMILES

CC1=C(C=CC(=C1)I)NC(=O)C2=NN(C(=O)CC2)C3CCS(=O)(=O)C3

InChI

InChI=1S/C16H18IN3O4S/c1-10-8-11(17)2-3-13(10)18-16(22)14-4-5-15(21)20(19-14)12-6-7-25(23,24)9-12/h2-3,8,12H,4-7,9H2,1H3,(H,18,22)